2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-4-(2,5-dimethylphenyl)phthalazin-1-one

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Openeye Name: 4-(2,5-dimethylphenyl)-2-(2-indolin-1-yl-2-oxo-ethyl)phthalazin-1-one CAS Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-4-(2,5-dimethylphenyl)-1-phthalazinone IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Traditional Name: 4-(2,5-dimethylphenyl)-2-(2-indolin-1-yl-2-keto-ethyl)phthalazin-1-one Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C26H23N3O2/c1-17-11-12-18(2)22(15-17)25-20-8-4-5-9-21(20)26(31)29(27-25)16-24(30)28-14-13-19-7-3-6-10-23(19)28/h3-12,15H,13-14,16H2,1-2H3